ID: 59662
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 59663
SMILES:C1CC2C(Cc3cc(OC(C(C)(C)C)=O)ccc3OC2(C)C)C(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -15.52
InChIKey:SKNFVWHEQBUXLQ-UHFFFAOYSA-N
ID: 59664
SMILES:C1C(C(C)=C)C(c2c(O)cc(CCCC)c(O)c2O)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -17.849
InChIKey:YOXQZMKONUTMMC-UHFFFAOYSA-N
ID: 59665
SMILES:C(C1=CC2C(C(C)(C)Oc3c2c(OC)cc(O)c3C(OC)=O)CC1=O)C(OC)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.524
CB1 binding score: -11.997
InChIKey:DOJHNHGWPVJMHK-UHFFFAOYSA-N
ID: 59666
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(C(=O)O)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 59667
SMILES:C(c1c2c(c(C)cc1O)OC(C=C(C)C)CC2C)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -13.933
InChIKey:ATHYBKVTMFHAHC-UHFFFAOYSA-N
ID: 59668
SMILES:c1(CCCC)c(C)c(O)c(O)c2c1OC(C)(C)C1C2C=C(C(O)=O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -14.798
InChIKey:NRSLROKDBKTAAY-UHFFFAOYSA-N
ID: 59669
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(C(C)(O)C2)OCC(C)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -16.254
InChIKey:ZWKIOPNFOUGDKH-UHFFFAOYSA-N
ID: 59670
SMILES:C1(C(=C)C)CCC(=C)C2C(c3c(cc(CCC)cc3O)O1)CC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 338.491
CB1 binding score: -14.332
InChIKey:JWRUSNFRMDBJOI-UHFFFAOYSA-N
ID: 59671
SMILES:C1C(C)(C)C2C(CC(C)(O)CC2)c2c(O)cc(CCCCC)cc21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -17.367
InChIKey:ZFXAKYPDCLUTPX-UHFFFAOYSA-N
ID: 59672
SMILES:c1cc(CCCCC)cc2c1C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.423
InChIKey:MRLLOLSGDYQJHB-UHFFFAOYSA-N
ID: 59673
SMILES:C1C(C)C2=C(C(C)(C)Oc3c2c(O)cc(CCC)c3)C(=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -14.641
InChIKey:LYXNPPCUQKLWFI-UHFFFAOYSA-N
ID: 59674
SMILES:C(CCCc1cc2c(c(O)c1)C1=C(C(C)(C)O2)CCC(C)C1)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.745
InChIKey:OORFXDSWECAQLI-UHFFFAOYSA-N
ID: 59675
SMILES:Cc1c(C2C(C(C)C)CCC(C)=C2)c(O)cc(CCCCC)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -16.299
InChIKey:VAWXMXABEFVXJQ-UHFFFAOYSA-N
ID: 59676
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)c1c-2cc(O)c(OC)c1)CC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.473
CB1 binding score: -14.98
InChIKey:JMXICHAZRPAMKP-UHFFFAOYSA-N
ID: 59677
SMILES:C(c1c(C(OC)=O)c(O)c(CC=C(CCC=C(C)C)C)c(O)c1)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -18.118
InChIKey:NEUABICYMUWBFX-UHFFFAOYSA-N
ID: 59678
SMILES:C(C)Cc1cc(O)c(CC=C(CCC=C(C)CCC=C(C)C)C)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 356.55
CB1 binding score: -17.698
InChIKey:JDMYRJILRCQJAV-UHFFFAOYSA-N
ID: 59679
SMILES:c1(CC=CC(C)=C)cc(O)c(C2C=C(C)CCC2C(C)=C)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 308.465
CB1 binding score: -16.478
InChIKey:HDSBILBITYVHBI-UHFFFAOYSA-N
ID: 59680
SMILES:C1CC2C(=CC1C)c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.727
InChIKey:YLTWYAXWDLZZCU-UHFFFAOYSA-N
ID: 59681
SMILES:C12C(C)COC1(C)Oc1c2c(OC)cc(CCCCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -15.519
InChIKey:DJGJNKMPNFWJSQ-UHFFFAOYSA-N
ID: 59682
SMILES:c1c(CCCC)cc2c(c1)OC(CCC=C(C)C)(C)CC2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -13.748
InChIKey:UQHQUKHXTSTLSC-UHFFFAOYSA-N